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Substance Name: Butyric acid, 4-(p-(bis(2-chloroethyl)amino)phenoxy)-
RN: 92318-13-3
InChIKey: TYQMDPHMWGNQLJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-Cl2-N-O3

Molecular Weight

  • 320.214
 
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Names and Synonyms

Synonyms

  • 4-(p-(Bis(2-chloroethyl)amino)phenoxy)butyric acid
  • 4-13-00-01049 (Beilstein Handbook Reference)
  • BRN 2873561
  • CB 1365

Systematic Name

  • Butyric acid, 4-(p-(bis(2-chloroethyl)amino)phenoxy)-

Registry Numbers

CAS Registry Number

  • 92318-13-3

System Generated Number

  • 0092318133

Structure Descriptors

InChI

1S/C14H19Cl2NO3/c15-7-9-17(10-8-16)12-3-5-13(6-4-12)20-11-1-2-14(18)19/h3-6H,1-2,7-11H2,(H,18,19)

InChIKey

TYQMDPHMWGNQLJ-UHFFFAOYSA-N

Smiles

c1(N(CCCl)CCCl)ccc(OCCCC(O)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intraperitoneal 14mg/kg (14mg/kg)   Biochemical Pharmacology. Vol. 5, Pg. 192, 1960.